Geometry & MOs

Info

ID:	380526
PubChem CID:	134971006
Reduced:	C7H9 (2)
Stoich.:	A7B9 (2)
Weight, g/mol:	437.183838
ΔH_f, kcal/mol:	23.27
Dipole, Da:	1.59
IP(EA), eV:	-8.18(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (4S,6S,7S,8R)-4,6-dimethyl-1-oxo-4,6-diphenyl-3,7,8,8a-tetrahydropyrrolo[2,1-c][1,4]oxazine-7,8-dicarboxylate

Drug info:

PubChemData

Smile

CC1CC(=C2C=C(C(=C2)C)C)C=C1C

DOS

IR

Vibrations